LAMMPS (28 Feb 2019)
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (src/comm.cpp:88)
  using 1 OpenMP thread(s) per MPI task
# Test case / example for fix electron/stopping
# Perfect Si lattice with one primary knock-on atom.
#
# Also uses fix dt/reset, as one should when energies are high
# enough to require electronic stopping.

units metal
boundary p p p
timestep 0.0001

lattice fcc 5.431
Lattice spacing in x,y,z = 5.431 5.431 5.431

region rbox block -10 10 -10 10 -10 10
create_box 1 rbox
Created orthogonal box = (-54.31 -54.31 -54.31) to (54.31 54.31 54.31)
  1 by 1 by 1 MPI processor grid

mass 1 28.0855

create_atoms 1 box
Created 32000 atoms
  create_atoms CPU = 0.00282311 secs

velocity all create 300 42534 mom yes rot yes

group gPKA id 1
1 atoms in group gPKA
velocity gPKA set 1120 1620 389

pair_style sw
pair_coeff * * Si.sw Si
Reading potential file Si.sw with DATE: 2007-06-11

fix fdt all dt/reset 1 NULL 0.001 0.1 emax 20.0
fix fel all electron/stopping 1.0 Si.Si.elstop
fix fnve all nve

thermo 10
thermo_style custom step time dt f_fel

#compute ek all ke/atom
#dump mydump all custom 200 elstop.dump id x y z vx vy vz fx fy fz c_ek

run 5000
Neighbor list info ...
  update every 1 steps, delay 10 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 5.77118
  ghost atom cutoff = 5.77118
  binsize = 2.88559, bins = 38 38 38
  2 neighbor lists, perpetual/occasional/extra = 1 1 0
  (1) pair sw, perpetual
      attributes: full, newton on
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
  (2) fix electron/stopping, occasional, copy from (1)
      attributes: full, newton on
      pair build: copy
      stencil: none
      bin: none
Per MPI rank memory allocation (min/avg/max) = 10.89 | 10.89 | 10.89 Mbytes
Step Time Dt f_fel 
       0            0  4.98128e-05            0 
      10 0.00030141297 7.4132113e-06    143.83504 
      20 0.00035951427 6.0316944e-06    171.53673 
      30 0.00057458971 3.5117251e-05    274.07596 
      40 0.00086591312 5.8243334e-06    412.87446 
      50 0.00090045701 2.1026443e-06    429.31458 
      60 0.00091828462 1.5368285e-06    437.79421 
      70 0.00093305888 1.4643253e-06    444.81982 
      80 0.00094860749 1.7487528e-06    452.21378 
      90 0.00097032161 3.0786693e-06    462.54244 
     100 0.0010787914 4.9354535e-05    514.16832 
     110 0.0012080771 2.321306e-06    575.68374 
     120 0.0012239682 1.0510328e-06    583.23471 
     130 0.0012325497 6.8272619e-07    587.30872 
     140 0.0012385196 5.1205819e-07    590.14077 
     150  0.001243165 4.1524338e-07    592.34294 
     160 0.0012470201 3.5380824e-07     594.1694 
     170 0.0012503578 3.1203776e-07    595.74992 
     180 0.0012533367 2.8236408e-07    597.15986 
     190 0.0012560575 2.6071908e-07    598.44711 
     200 0.0012585888 2.4474123e-07    599.64431 
     210 0.0012609803 2.3298466e-07    600.77504 
     220 0.0012632696 2.2453464e-07    601.85726 
     230 0.0012654871 2.1880713e-07    602.90531 
     240 0.0012676582 2.1543942e-07    603.93128 
     250 0.0012698054 2.1422997e-07    604.94591 
     260 0.0012719499 2.1510772e-07    605.95925 
     270 0.0012741128 2.1812163e-07    606.98126 
     280 0.0012763159 2.2344765e-07    608.02243 
     290 0.0012785839 2.3141489e-07    609.09436 
     300 0.0012809453 2.425587e-07    610.21066 
     310 0.0012834353 2.577174e-07    611.38806 
     320 0.0012860996 2.7820843e-07    612.64822 
     330 0.0012890001 3.0616141e-07    614.02061 
     340 0.0012922261 3.4518994e-07    615.54764 
     350 0.0012959145 4.0187423e-07    617.29438 
     360 0.0013002933 4.894618e-07    619.36917 
     370 0.0013057872 6.3886828e-07    621.97388 
     380 0.0013133355 9.4153332e-07    625.55502 
     390 0.0013257779 1.8246429e-06    631.46263 
     400 0.0013651328 1.4820738e-05    650.16503 
     410 0.0016916358 4.5528312e-05     805.3327 
     420 0.0020836696 2.6189823e-05    991.45963 
     430  0.002192113 5.1312984e-06    1042.8979 
     440 0.0022530638 1.1643276e-05    1071.7967 
     450 0.0025312898 1.5833134e-05    1203.6961 
     460 0.0028677695 3.9078523e-05    1363.0792 
     470 0.0032653301 3.9299497e-05    1551.2027 
     480 0.0036647478 4.1100578e-05    1739.9906 
     490 0.0040772194 3.6017871e-05    1934.7262 
     500  0.004246426 1.1620229e-05    2014.5366 
     510 0.0045410379 2.1151987e-05    2153.4172 
     520 0.0048951987 4.2067206e-05    2320.2216 
     530 0.0051251181 5.9152255e-06    2428.4156 
     540 0.0051740847 5.0188036e-06    2451.4388 
     550 0.0053207575 4.1618335e-05    2520.4067 
     560 0.0054412772 2.3641932e-06    2577.0541 
     570  0.005457552 1.0847369e-06    2584.6937 
     580 0.0054664476 7.1198746e-07    2588.8658 
     590 0.0054726999 5.3933302e-07     2591.796 
     600 0.0054776139 4.4178461e-07    2594.0976 
     610 0.0054817341 3.8039473e-07    2596.0263 
     620 0.0054853401 3.3924667e-07    2597.7135 
     630 0.0054885957 3.1069211e-07    2599.2361 
     640 0.0054916066 2.9064829e-07    2600.6439 
     650 0.0054944462 2.7678405e-07    2601.9712 
     660 0.0054971697 2.6772348e-07     2603.244 
     670 0.0054998211 2.6266505e-07    2604.4829 
     680 0.0055024383 2.6119265e-07    2605.7058 
     690 0.0055050563 2.6318733e-07     2606.929 
     700 0.0055077103 2.6880326e-07    2608.1691 
     710 0.0055104383 2.7849814e-07    2609.4439 
     720 0.0055132846 2.9313007e-07    2610.7742 
     730 0.0055163044 3.141612e-07     2612.186 
     740 0.0055195719 3.4406726e-07     2613.714 
     750 0.0055231932 3.8719688e-07    2615.4081 
     760 0.0055273329 4.5174267e-07    2617.3455 
     770 0.0055322712 5.5490406e-07    2619.6579 
     780 0.0055385515 7.3934538e-07    2622.6004 
     790 0.0055474645 1.1452909e-06    2626.7792 
     800 0.0055635927 2.6160295e-06    2634.3465 
     810 0.0057044835 3.9642931e-05    2700.5132 
     820 0.0060307501 2.9394558e-05    2853.6539 
     830 0.0063374404 8.5188148e-06    2997.4768 
     840 0.0063740052 1.4828325e-06    3014.6052 
     850 0.0063848364 7.5985425e-07    3019.6727 
     860 0.0063911095 5.0258852e-07    3022.6045 
     870 0.0063954921 3.7335256e-07    3024.6508 
     880 0.0063988506 2.9643864e-07    3026.2175 
     890 0.0064015712 2.4575869e-07    3027.4855 
     900 0.0064038584 2.1001191e-07    3028.5506 
     910 0.0064058333 1.8353805e-07    3029.4694 
     920  0.006407573 1.6320008e-07    3030.2782 
     930 0.0064091297 1.4712417e-07    3031.0014 
     940 0.0064105403 1.3412445e-07    3031.6562 
     950 0.0064118317 1.2341509e-07    3032.2552 
     960 0.0064130243 1.1445544e-07     3032.808 
     970 0.0064141337 1.0686175e-07    3033.3219 
     980 0.0064151722 1.0035437e-07    3033.8027 
     990 0.0064161498 9.4724852e-08    3034.2549 
    1000 0.0064170744 8.9814769e-08    3034.6824 
    1010 0.0064179527 8.5501639e-08    3035.0882 
    1020 0.0064187902 8.1689338e-08     3035.475 
    1030 0.0064195915 7.8301418e-08    3035.8449 
    1040 0.0064203606 7.5276356e-08    3036.1997 
    1050 0.0064211009 7.2564109e-08     3036.541 
    1060 0.0064218154 7.0123584e-08    3036.8703 
    1070 0.0064225065 6.7920744e-08    3037.1886 
    1080 0.0064231766 6.5927178e-08    3037.4971 
    1090 0.0064238276 6.4119002e-08    3037.7967 
    1100 0.0064244613 6.2476011e-08    3038.0882 
    1110 0.0064250792 6.0981016e-08    3038.3724 
    1120 0.0064256828 5.9619315e-08    3038.6498 
    1130 0.0064262733 5.8378279e-08    3038.9212 
    1140 0.0064268519 5.7247013e-08    3039.1869 
    1150 0.0064274196 5.6216088e-08    3039.4476 
    1160 0.0064279775 5.5277318e-08    3039.7037 
    1170 0.0064285264 5.4423582e-08    3039.9556 
    1180  0.006429067 5.3648672e-08    3040.2036 
    1190 0.0064296003 5.294717e-08    3040.4482 
    1200 0.0064301269 5.2314351e-08    3040.6897 
    1210 0.0064306474 5.1746091e-08    3040.9283 
    1220 0.0064311625 5.1238802e-08    3041.1644 
    1230 0.0064316729 5.0789368e-08    3041.3983 
    1240 0.0064321789 5.0395101e-08    3041.6301 
    1250 0.0064326813 5.0053692e-08    3041.8603 
    1260 0.0064331805 4.9763183e-08    3042.0889 
    1270  0.006433677 4.9521937e-08    3042.3163 
    1280 0.0064341713 4.9328614e-08    3042.5427 
    1290 0.0064346639 4.9182151e-08    3042.7682 
    1300 0.0064351552 4.9081752e-08    3042.9931 
    1310 0.0064356458 4.9026872e-08    3043.2177 
    1320  0.006436136 4.9017214e-08    3043.4421 
    1330 0.0064366262 4.9052721e-08    3043.6666 
    1340 0.0064371171 4.9133581e-08    3043.8912 
    1350  0.006437609 4.9260223e-08    3044.1164 
    1360 0.0064381023 4.9433327e-08    3044.3422 
    1370 0.0064385976 4.9653831e-08     3044.569 
    1380 0.0064390953 4.9922944e-08    3044.7968 
    1390 0.0064395959 5.0242164e-08    3045.0261 
    1400    0.0064401 5.0613297e-08    3045.2568 
    1410  0.006440608 5.1038483e-08    3045.4895 
    1420 0.0064411205 5.1520228e-08    3045.7242 
    1430 0.0064416381 5.2061443e-08    3045.9613 
    1440 0.0064421614 5.2665486e-08     3046.201 
    1450  0.006442691 5.3336219e-08    3046.4437 
    1460 0.0064432276 5.4078074e-08    3046.6896 
    1470  0.006443772 5.4896126e-08    3046.9392 
    1480 0.0064443249 5.5796191e-08    3047.1927 
    1490 0.0064448873 5.6784937e-08    3047.4506 
    1500 0.0064454599 5.7870017e-08    3047.7132 
    1510 0.0064460439 5.9060235e-08    3047.9812 
    1520 0.0064466403 6.0365742e-08    3048.2549 
    1530 0.0064472503 6.1798287e-08    3048.5349 
    1540 0.0064478752 6.337151e-08     3048.822 
    1550 0.0064485166 6.5101323e-08    3049.1166 
    1560  0.006449176 6.7006371e-08    3049.4197 
    1570 0.0064498554 6.9108623e-08     3049.732 
    1580 0.0064505567 7.1434118e-08    3050.0546 
    1590 0.0064512824 7.4013931e-08    3050.3885 
    1600 0.0064520352 7.6885409e-08    3050.7351 
    1610 0.0064528182 8.0093813e-08    3051.0957 
    1620  0.006453635 8.3694486e-08     3051.472 
    1630 0.0064544898 8.7755778e-08    3051.8661 
    1640 0.0064553876 9.2363047e-08    3052.2802 
    1650 0.0064563343 9.7624226e-08    3052.7171 
    1660 0.0064573371 1.0367771e-07    3053.1801 
    1670 0.0064584046 1.1070379e-07    3053.6733 
    1680 0.0064595476 1.1894157e-07    3054.2017 
    1690 0.0064607796 1.2871484e-07    3054.7716 
    1700 0.0064621178 1.4047265e-07     3055.391 
    1710 0.0064635847 1.5485559e-07    3056.0705 
    1720 0.0064652106 1.7280864e-07    3056.8241 
    1730 0.0064670371 1.9578361e-07    3057.6713 
    1740 0.0064691241 2.261258e-07    3058.6401 
    1750 0.0064715615 2.6787347e-07    3059.7724 
    1760 0.0064744931 3.2858822e-07    3061.1353 
    1770 0.0064781697 4.2416554e-07    3062.8461 
    1780 0.0064830857 5.9426003e-07    3065.1356 
    1790 0.0064904338 9.7042692e-07    3068.5608 
    1800  0.006504521 2.3570057e-06    3075.1339 
    1810 0.0066489551 2.5350137e-05     3142.596 
    1820 0.0067263358 2.0982567e-06    3178.7218 
    1830 0.0067413263 1.0389873e-06    3185.7117 
    1840 0.0067499639 7.021379e-07     3189.736 
    1850 0.0067561793 5.4125252e-07    3192.6298 
    1860   0.00676114 4.4920623e-07     3194.938 
    1870 0.0067653505 3.911598e-07    3196.8961 
    1880 0.0067690759 3.5254253e-07    3198.6279 
    1890 0.0067724748 3.2626983e-07    3200.2074 
    1900 0.0067756518 3.0855768e-07    3201.6834 
    1910 0.0067786819 2.9728199e-07    3203.0908 
    1920 0.0067816236 2.9125633e-07     3204.457 
    1930 0.0067845263 2.8989566e-07    3205.8049 
    1940 0.0067874357 2.9306921e-07     3207.156 
    1950 0.0067903982 3.0106889e-07    3208.5318 
    1960  0.006793465 3.1467844e-07    3209.9563 
    1970 0.0067966982 3.3537556e-07    3211.4583 
    1980 0.0068001793 3.6577201e-07    3213.0759 
    1990 0.0068040239 4.1056728e-07     3214.863 
    2000 0.0068084116 4.7878365e-07    3216.9034 
    2010 0.0068136505 5.897605e-07    3219.3409 
    2020 0.0068203489 7.9292336e-07    3222.4591 
    2030 0.0068300039 1.259738e-06    3226.9568 
    2040 0.0068484332 3.1869606e-06    3235.5484 
    2050   0.00704302 3.1308435e-05    3326.3332 
    2060 0.0073582601 1.9393034e-05    3473.3099 
    2070 0.0076291992 6.1118973e-06    3599.5265 
    2080 0.0076591273 1.397136e-06    3613.4525 
    2090 0.0076695786 7.5324795e-07      3618.31 
    2100 0.0076758692 5.1095756e-07    3621.2308 
    2110 0.0076803593 3.8613872e-07    3623.3137 
    2120 0.0076838539 3.1077232e-07    3624.9334 
    2130 0.0076867208 2.6065521e-07    3626.2611 
    2140 0.0076891581 2.2509342e-07    3627.3889 
    2150  0.007691284 1.9865679e-07     3628.372 
    2160 0.0076931748 1.7830513e-07    3629.2457 
    2170 0.0076948825 1.6220815e-07    3630.0343 
    2180 0.0076964439 1.4920028e-07    3630.7548 
    2190 0.0076978861 1.3850522e-07      3631.42 
    2200 0.0076992297 1.2958672e-07    3632.0393 
    2210 0.0077004907 1.2206289e-07    3632.6203 
    2220 0.0077016817 1.1565477e-07    3633.1687 
    2230 0.0077028128 1.1015407e-07    3633.6892 
    2240 0.0077038924 1.0540234e-07    3634.1859 
    2250 0.0077049274 1.0127711e-07    3634.6618 
    2260 0.0077059236 9.7682361e-08    3635.1197 
    2270 0.0077068859 9.454193e-08    3635.5619 
    2280 0.0077078187 9.1794781e-08    3635.9903 
    2290 0.0077087255 8.9391579e-08    3636.4067 
    2300 0.0077096098 8.7292175e-08    3636.8125 
    2310 0.0077104742 8.5463727e-08    3637.2092 
    2320 0.0077113216 8.3879281e-08     3637.598 
    2330  0.007712154 8.2516693e-08    3637.9798 
    2340 0.0077129738 8.1357804e-08    3638.3557 
    2350 0.0077137829 8.0387796e-08    3638.7267 
    2360 0.0077145831 7.9594705e-08    3639.0935 
    2370 0.0077153761 7.8969036e-08     3639.457 
    2380 0.0077161635 7.8503481e-08    3639.8178 
    2390  0.007716947 7.8192701e-08    3640.1769 
    2400 0.0077177281 7.8033171e-08    3640.5348 
    2410 0.0077185083 7.8023089e-08    3640.8923 
    2420  0.007719289 7.8162318e-08      3641.25 
    2430 0.0077200718 7.8452384e-08    3641.6087 
    2440 0.0077208582 7.8896522e-08    3641.9691 
    2450 0.0077216498 7.9499759e-08    3642.3318 
    2460 0.0077224481 8.026906e-08    3642.6977 
    2470 0.0077232549 8.1213529e-08    3643.0675 
    2480 0.0077240719 8.2344683e-08     3643.442 
    2490 0.0077249012 8.3676812e-08    3643.8222 
    2500 0.0077257448 8.5227445e-08     3644.209 
    2510 0.0077266049 8.7017961e-08    3644.6035 
    2520 0.0077274841 8.9074372e-08    3645.0068 
    2530 0.0077283852 9.1428349e-08    3645.4203 
    2540 0.0077293113 9.4118559e-08    3645.8454 
    2550 0.0077302659 9.7192441e-08    3646.2837 
    2560 0.0077312533 1.0070857e-07    3646.7372 
    2570 0.0077322781 1.0473987e-07     3647.208 
    2580 0.0077333458 1.0937801e-07    3647.6987 
    2590  0.007734463 1.1473957e-07    3648.2124 
    2600 0.0077356377 1.2097481e-07    3648.7528 
    2610 0.0077368793 1.2828037e-07    3649.3242 
    2620 0.0077381998 1.3691837e-07    3649.9322 
    2630 0.0077396139 1.4724543e-07    3650.5836 
    2640 0.0077411406 1.5975888e-07    3651.2873 
    2650 0.0077428048 1.7517253e-07    3652.0548 
    2660 0.0077446398 1.9454711e-07    3652.9016 
    2670 0.0077466922 2.1952673e-07    3653.8493 
    2680 0.0077490288 2.5279733e-07     3654.929 
    2690 0.0077517515 2.9905194e-07     3656.188 
    2700 0.0077550252 3.6725589e-07    3657.7029 
    2710 0.0077591434 4.7681009e-07    3659.6101 
    2720 0.0077647038 6.7839241e-07    3662.1874 
    2730  0.007773234 1.1552111e-06    3666.1446 
    2740 0.0077911374 3.3406902e-06     3674.458 
    2750    0.0079702 8.4184292e-06    3757.6696 
    2760  0.008006114 1.4496754e-06    3774.3449 
    2770 0.0080166835 7.3926386e-07    3779.2462 
    2780 0.0080227734 4.8640717e-07    3782.0672 
    2790 0.0080270055 3.5945058e-07    3784.0255 
    2800 0.0080302318 2.8394384e-07     3785.517 
    2810  0.008032832 2.3422206e-07    3786.7179 
    2820 0.0080350072 1.9916814e-07    3787.7215 
    2830 0.0080368761 1.7321525e-07    3788.5831 
    2840 0.0080385144 1.5327931e-07    3789.3377 
    2850 0.0080399734 1.3751893e-07    3790.0091 
    2860 0.0080412891 1.2476931e-07    3790.6141 
    2870 0.0080424879 1.1425897e-07    3791.1649 
    2880 0.0080435897 1.0545738e-07    3791.6707 
    2890 0.0080446097 9.7988142e-08    3792.1386 
    2900 0.0080455599 9.1577084e-08    3792.5741 
    2910   0.00804645 8.6019912e-08    3792.9818 
    2920 0.0080472879 8.1161402e-08    3793.3653 
    2930 0.0080480798 7.6881575e-08    3793.7275 
    2940 0.0080488311 7.3086284e-08    3794.0709 
    2950 0.0080495465 6.9700651e-08    3794.3977 
    2960 0.0080502295 6.666441e-08    3794.7094 
    2970 0.0080508836 6.3928523e-08    3795.0078 
    2980 0.0080515116 6.1452701e-08    3795.2941 
    2990 0.0080521158 5.9203545e-08    3795.5694 
    3000 0.0080526985 5.7153146e-08    3795.8346 
    3010 0.0080532614 5.5278009e-08    3796.0908 
    3020 0.0080538063 5.3558217e-08    3796.3386 
    3030 0.0080543347 5.1976785e-08    3796.5788 
    3040 0.0080548478 5.051914e-08    3796.8119 
    3050 0.0080553469 4.9172716e-08    3797.0385 
    3060 0.0080558329 4.7926619e-08    3797.2591 
    3070 0.0080563069 4.6771366e-08    3797.4741 
    3080 0.0080567697 4.5698662e-08    3797.6839 
    3090 0.0080572222 4.4701228e-08    3797.8889 
    3100 0.0080576649 4.3772647e-08    3798.0895 
    3110 0.0080580987 4.2907247e-08    3798.2858 
    3120 0.0080585241 4.2099999e-08    3798.4784 
    3130 0.0080589417 4.1346425e-08    3798.6672 
    3140 0.0080593519 4.0642535e-08    3798.8527 
    3150 0.0080597554 3.9984758e-08    3799.0351 
    3160 0.0080601524 3.9369895e-08    3799.2145 
    3170 0.0080605435 3.8795073e-08    3799.3911 
    3180  0.008060929 3.8257705e-08    3799.5651 
    3190 0.0080613093 3.7755461e-08    3799.7368 
    3200 0.0080616847 3.7286239e-08    3799.9062 
    3210 0.0080620556 3.6848135e-08    3800.0734 
    3220 0.0080624222 3.6439432e-08    3800.2387 
    3230 0.0080627848 3.6058573e-08    3800.4022 
    3240 0.0080631438 3.5704146e-08     3800.564 
    3250 0.0080634994 3.5374876e-08    3800.7241 
    3260 0.0080638517 3.5069606e-08    3800.8828 
    3270 0.0080642011 3.4787289e-08    3801.0402 
    3280 0.0080645478 3.4526978e-08    3801.1962 
    3290  0.008064892 3.4287819e-08    3801.3511 
    3300 0.0080652339 3.4069042e-08     3801.505 
    3310 0.0080655736 3.3869955e-08    3801.6578 
    3320 0.0080659115 3.368994e-08    3801.8098 
    3330 0.0080662477 3.3528444e-08     3801.961 
    3340 0.0080665823 3.3384981e-08    3802.1115 
    3350 0.0080669156 3.3259123e-08    3802.2613 
    3360 0.0080672476 3.3150499e-08    3802.4106 
    3370 0.0080675787 3.305879e-08    3802.5594 
    3380  0.008067909 3.2983732e-08    3802.7078 
    3390 0.0080682385 3.2925108e-08    3802.8559 
    3400 0.0080685676 3.288275e-08    3803.0038 
    3410 0.0080688963 3.2856537e-08    3803.1515 
    3420 0.0080692248 3.2846395e-08    3803.2991 
    3430 0.0080695532 3.2852293e-08    3803.4466 
    3440 0.0080698819 3.2874247e-08    3803.5943 
    3450 0.0080702108 3.2912319e-08     3803.742 
    3460 0.0080705401 3.2966617e-08      3803.89 
    3470 0.0080708701 3.3037293e-08    3804.0382 
    3480 0.0080712008 3.312455e-08    3804.1868 
    3490 0.0080715325 3.3228638e-08    3804.3358 
    3500 0.0080718653 3.3349858e-08    3804.4853 
    3510 0.0080721995 3.3488567e-08    3804.6355 
    3520  0.008072535 3.3645172e-08    3804.7862 
    3530 0.0080728723 3.3820145e-08    3804.9378 
    3540 0.0080732113 3.4014016e-08    3805.0901 
    3550 0.0080735524 3.4227383e-08    3805.2434 
    3560 0.0080738957 3.4460914e-08    3805.3977 
    3570 0.0080742414 3.4715354e-08    3805.5532 
    3580 0.0080745898 3.4991532e-08    3805.7098 
    3590 0.0080749411 3.5290364e-08    3805.8677 
    3600 0.0080752954 3.5612865e-08    3806.0271 
    3610 0.0080756531 3.5960156e-08     3806.188 
    3620 0.0080760143 3.6333475e-08    3806.3505 
    3630 0.0080763794 3.6734187e-08    3806.5148 
    3640 0.0080767487 3.7163802e-08     3806.681 
    3650 0.0080771224 3.7623985e-08    3806.8492 
    3660 0.0080775008 3.8116577e-08    3807.0196 
    3670 0.0080778843 3.8643614e-08    3807.1924 
    3680 0.0080782733 3.9207349e-08    3807.3676 
    3690  0.008078668 3.9810283e-08    3807.5455 
    3700  0.008079069 4.0455191e-08    3807.7262 
    3710 0.0080794766 4.114516e-08      3807.91 
    3720 0.0080798913 4.1883634e-08    3808.0971 
    3730 0.0080803137 4.2674459e-08    3808.2877 
    3740 0.0080807442 4.3521941e-08     3808.482 
    3750 0.0080811834 4.4430917e-08    3808.6803 
    3760 0.0080816321 4.5406834e-08     3808.883 
    3770 0.0080820908 4.6455843e-08    3809.0902 
    3780 0.0080825604 4.7584918e-08    3809.3025 
    3790 0.0080830416 4.8801987e-08    3809.5201 
    3800 0.0080835355 5.0116105e-08    3809.7436 
    3810 0.0080840429 5.1537653e-08    3809.9733 
    3820 0.0080845652 5.3078583e-08    3810.2097 
    3830 0.0080851034 5.4752728e-08    3810.4535 
    3840  0.008085659 5.6576175e-08    3810.7054 
    3850 0.0080862335 5.8567743e-08    3810.9659 
    3860 0.0080868289 6.0749572e-08     3811.236 
    3870  0.008087447 6.3147889e-08    3811.5166 
    3880 0.0080880901 6.5793981e-08    3811.8087 
    3890  0.008088761 6.8725458e-08    3812.1136 
    3900 0.0080894626 7.1987928e-08    3812.4327 
    3910 0.0080901986 7.5637206e-08    3812.7675 
    3920  0.008090973 7.9742316e-08    3813.1201 
    3930 0.0080917909 8.4389592e-08    3813.4926 
    3940  0.008092658 8.9688414e-08    3813.8879 
    3950 0.0080935816 9.5779352e-08    3814.3091 
    3960 0.0080945703 1.0284601e-07    3814.7604 
    3970 0.0080956349 1.1113264e-07    3815.2467 
    3980 0.0080967891 1.2097115e-07    3815.7742 
    3990 0.0080980502 1.3282379e-07    3816.3511 
    4000 0.0080994413 1.4735308e-07    3816.9878 
    4010 0.0081009931 1.6554202e-07    3817.6987 
    4020 0.0081027486 1.8891116e-07    3818.5035 
    4030 0.0081047696 2.1993774e-07    3819.4308 
    4040 0.0081071501 2.6293325e-07     3820.524 
    4050 0.0081100418 3.2608623e-07    3821.8531 
    4060 0.0081137136 4.2695471e-07    3823.5422 
    4070 0.0081187073 6.1068659e-07    3825.8415 
    4080 0.0081263808 1.0353843e-06    3829.3781 
    4090 0.0081421033 2.8175459e-06    3836.6316 
    4100 0.0083319479 3.0660994e-05     3924.296 
    4110 0.0086521081 2.4031675e-05    4072.0381 
    4120 0.0089367803 5.8263834e-06    4203.2922 
    4130 0.0089679114 1.6262217e-06    4217.6293 
    4140 0.0089805825 9.6546502e-07    4223.4594 
    4150 0.0089889356 7.1159925e-07    4227.3001 
    4160 0.0089954101 5.8311893e-07    4230.2754 
    4170 0.0090008803 5.1000973e-07    4232.7881 
    4180 0.0090057682 4.6713078e-07    4235.0326 
    4190 0.0090103206 4.4370361e-07    4237.1225 
    4200 0.0090147071 4.3491502e-07    4239.1361 
    4210 0.0090190645 4.3912951e-07    4241.1362 
    4220 0.0090235243 4.570826e-07    4243.1834 
    4230 0.0090282367 4.9222468e-07    4245.3469 
    4240 0.0090334045 5.5254852e-07      4247.72 
    4250 0.0090393478 6.5600428e-07    4250.4502 
    4260 0.0090466656 8.4827393e-07    4253.8133 
    4270 0.0090567641 1.2818738e-06     4258.457 
    4280 0.0090746835 2.9033891e-06    4266.7027 
    4290 0.0092346752 2.9451638e-05    4340.3839 
    4300 0.0093466586 4.9023913e-06    4391.9319 
    4310 0.0093992941 7.8400922e-06     4416.149 
    4320 0.0097053159 4.3362296e-05    4556.9393 
    4330  0.010037349 4.9648086e-05    4709.5604 
    4340  0.010297354 8.8232096e-06    4828.9697 
    4350  0.010503113 4.4016316e-05    4923.4016 
    4360  0.010926633 4.2142313e-05     5117.622 
    4370  0.011318805 4.0285407e-05    5297.2575 
    4380  0.011746199 4.3755472e-05    5492.8047 
    4390  0.012044606 2.1150168e-05    5629.1924 
    4400   0.01231664 7.0784321e-06    5753.4243 
    4410   0.01236554 3.954763e-06    5775.7358 
    4420     0.012415 8.8450437e-06    5798.2999 
    4430  0.012723996 3.6113036e-05    5939.2622 
    4440  0.013109261 4.5827638e-05    6114.8493 
    4450  0.013251276 2.6649019e-06    6179.5172 
    4460  0.013269544 1.2200106e-06    6187.8251 
    4470  0.013279619 8.155501e-07    6192.4028 
    4480  0.013286853 6.3300974e-07    6195.6879 
    4490   0.01329269 5.3347649e-07    6198.3373 
    4500  0.013297735 4.7451627e-07    6200.6261 
    4510  0.013302306 4.392029e-07    6202.6992 
    4520  0.013306599 4.1982963e-07    6204.6461 
    4530  0.013310757 4.1285331e-07    6206.5311 
    4540  0.013314895 4.1710029e-07    6208.4074 
    4550  0.013319128 4.3324769e-07    6210.3267 
    4560  0.013323586 4.6410935e-07     6212.348 
    4570  0.013328439 5.1597347e-07    6214.5493 
    4580   0.01333395 6.0235495e-07    6217.0498 
    4590  0.013340584 7.5537668e-07    6220.0613 
    4600  0.013349342 1.0699582e-06    6224.0388 
    4610  0.013363183  1.98365e-06    6230.3293 
    4620  0.013404081 1.4367775e-05    6248.9319 
    4630  0.013593325 3.787203e-06    6335.0239 
    4640   0.01361833 1.6441528e-06    6346.3866 
    4650  0.013632159 1.1592769e-06    6352.6667 
    4660  0.013642828 9.8623051e-07    6357.5101 
    4670  0.013652418 9.4451692e-07    6361.8626 
    4680  0.013662041 1.0034733e-06    6366.2295 
    4690  0.013672824 1.2061779e-06    6371.1243 
    4700  0.013686941 1.780995e-06    6377.5343 
    4710  0.013713088 4.7634009e-06    6389.4131 
    4720  0.013968014 3.9765415e-05    6505.2802 
    4730  0.014228787 6.2632217e-06    6623.7185 
    4740  0.014278333 4.7934169e-06    6646.2018 
    4750  0.014382212 5.1069055e-05    6693.3424 
    4760  0.014525205 2.0381123e-06    6758.2178 
    4770  0.014538504 8.2250651e-07    6764.2412 
    4780  0.014544984 4.9114353e-07    6767.1723 
    4790  0.014549144 3.4212232e-07    6769.0518 
    4800  0.014552156 2.589287e-07    6770.4109 
    4810  0.014554491 2.0641662e-07    6771.4633 
    4820  0.014556384 1.7052382e-07     6772.315 
    4830  0.014557966 1.4457875e-07    6773.0262 
    4840  0.014559319 1.250293e-07    6773.6339 
    4850  0.014560498  1.09819e-07    6774.1626 
    4860  0.014561539 9.7678962e-08     6774.629 
    4870   0.01456247 8.7785899e-08    6775.0453 
    4880   0.01456331 7.9583482e-08    6775.4205 
    4890  0.014564074 7.2682934e-08    6775.7613 
    4900  0.014564773 6.6804784e-08    6776.0732 
    4910  0.014565418 6.1743238e-08    6776.3601 
    4920  0.014566015 5.7343571e-08    6776.6256 
    4930  0.014566571 5.3487327e-08    6776.8723 
    4940   0.01456709 5.0082359e-08    6777.1026 
    4950  0.014567577 4.7055963e-08    6777.3183 
    4960  0.014568035 4.4350048e-08     6777.521 
    4970  0.014568467 4.1917669e-08     6777.712 
    4980  0.014568876 3.9720495e-08    6777.8926 
    4990  0.014569265 3.7726941e-08    6778.0636 
    5000  0.014569634 3.5910753e-08    6778.2261 
Loop time of 24.155 on 1 procs for 5000 steps with 32000 atoms

Performance: 0.001 ns/day, 37368.951 hours/ns, 206.996 timesteps/s
99.8% CPU use with 1 MPI tasks x 1 OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 15.795     | 15.795     | 15.795     |   0.0 | 65.39
Neigh   | 1.5182     | 1.5182     | 1.5182     |   0.0 |  6.29
Comm    | 0.58555    | 0.58555    | 0.58555    |   0.0 |  2.42
Output  | 0.0064323  | 0.0064323  | 0.0064323  |   0.0 |  0.03
Modify  | 5.619      | 5.619      | 5.619      |   0.0 | 23.26
Other   |            | 0.6313     |            |       |  2.61

Nlocal:    32000 ave 32000 max 32000 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Nghost:    13556 ave 13556 max 13556 min
Histogram: 1 0 0 0 0 0 0 0 0 0
Neighs:    0 ave 0 max 0 min
Histogram: 1 0 0 0 0 0 0 0 0 0
FullNghs:  576016 ave 576016 max 576016 min
Histogram: 1 0 0 0 0 0 0 0 0 0

Total # of neighbors = 576016
Ave neighs/atom = 18.0005
Neighbor list builds = 68
Dangerous builds = 42
Total wall time: 0:00:24
